Basic information
- CAS
18454-96-1- Standard SMILES
NC1=CN(CCc2ccccc2)[NH2+]O1.[Cl-]- InChIKey
FCPCFUYGXZDNQB-UHFFFAOYSA-N- Molecular formula
- C10H14ClN3O
- Average molar mass
- 227.69 g/mol
- Monoisotopic mass
- 227.0825398
Names & identifiers
- Preferred name
- 3-(2-Phenylethyl)-2,3-dihydro-1,2,3-oxadiazol-5-amine--hydrogen chloride (1/1)
- IUPAC
- 3-(2-phenylethyl)-2H-oxadiazol-2-ium-5-amine chloride
Names & synonyms
18454-96-1DTXSID609398423-(2-Phenylethyl)-2,3-dihydro-1,2,3-oxadiazol-5-amine--hydrogen chloride (1/1)RefChem:1066618DTXCID7013683293-Phenethylsydnone imine monohydrochlorideSydnone imine, 3-phenethyl-, monohydrochloride
Database identifiers
- CAS
18454-96-1- PubChem CID
- 205665
Properties
Computed structural properties
- Topological polar surface area
- 55.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 211
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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